2-(3-cyclohexyl-6-iodanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-(3-cyclohexyl-6-iodanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: 2-(3-cyclohexyl-6-iodo-4-oxo-quinazolin-2-yl)sulfanyl-N-phenyl-acetamide CAS Name: 2-[(3-cyclohexyl-6-iodo-4-oxo-2-quinazolinyl)thio]-N-phenylacetamide IUPAC Name: 2-(3-cyclohexyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N-phenylacetamide Traditional Name: 2-[(3-cyclohexyl-6-iodo-4-keto-quinazolin-2-yl)thio]-N-phenyl-acetamide Formula: C22H22IN3O2S MolecularWeight: 519.39845

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H22IN3O2S/c23-15-11-12-19-18(13-15)21(28)26(17-9-5-2-6-10-17)22(25-19)29-14-20(27)24-16-7-3-1-4-8-16/h1,3-4,7-8,11-13,17H,2,5-6,9-10,14H2,(H,24,27)